4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide

C19H14ClN3O2 — CID 100579855

IUPAC4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide
SMILESO=C(NCc1ccco1)c1ccc(-c2nc3ccc(Cl)cc3[nH]2)cc1
InChIInChI=1S/C19H14ClN3O2/c20-14-7-8-16-17(10-14)23-18(22-16)12-3-5-13(6-4-12)19(24)21-11-15-2-1-9-25-15/h1-10H,11H2,(H,21,24)(H,22,23)
InChIKeySUKBYIOYMLMADR-UHFFFAOYSA-N
MW351.79 g/mol
LogP4.41
Rot. Bonds4

About 4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide

4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide (PubChem CID 100579855) has the molecular formula C19H14ClN3O2 and a molecular weight of 351.79 g/mol. Its IUPAC name is 4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide
PubChem CID100579855
Molecular FormulaC19H14ClN3O2
Molecular Weight351.79 g/mol
Exact Mass351.08
IUPAC Name4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide
SMILESO=C(NCc1ccco1)c1ccc(-c2nc3ccc(Cl)cc3[nH]2)cc1
InChIInChI=1S/C19H14ClN3O2/c20-14-7-8-16-17(10-14)23-18(22-16)12-3-5-13(6-4-12)19(24)21-11-15-2-1-9-25-15/h1-10H,11H2,(H,21,24)(H,22,23)
InChIKeySUKBYIOYMLMADR-UHFFFAOYSA-N
XLogP4.41
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.79
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(6-chloro-1H-benzimidazol-2-yl)-N-ethylbenzamide
CID 100579654
4-(6-chloro-1H-benzimidazol-2-yl)-N-[(3,4-dichlorophenyl)methyl]benzamide
CID 44534673
4-(6-chloro-1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide
CID 100580067
3-(4-chlorophenyl)-N-(furan-2-ylmethyl)-2,1-benzoxazole-5-carboxamide
CID 22575714
2-chloro-N-(furan-2-ylmethyl)-1,3-benzothiazole-5-carboxamide
CID 100786923
2-[amino-(2-aminophenyl)methyl]-N-(furan-2-ylmethyl)-3H-benzimidazole-5-carboxamide
CID 163644327
2-(difluoromethyl)-N-[[3-(furan-2-ylmethylcarbamoyl)phenyl]methyl]-3H-benzimidazole-5-carboxamide
CID 56561104
4-(6-chloro-1H-benzimidazol-2-yl)-N-[(2S)-4-phenylbutan-2-yl]benzamide
CID 100580774
methyl 2-(4-chlorophenyl)-3H-benzimidazole-5-carboxylate
CID 3008656
4-(6-chloro-1H-benzimidazol-2-yl)-N-(3,4-dimethylphenyl)benzamide
CID 100579998
4-N-(furan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 27649984
2,3-diethyl-N-(furan-2-ylmethyl)quinoxaline-6-carboxamide
CID 2302300

Frequently Asked Questions

What is the IUPAC name of 4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide (CID 100579855) is 4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide is O=C(NCc1ccco1)c1ccc(-c2nc3ccc(Cl)cc3[nH]2)cc1.
What is the InChIKey of 4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide?
The InChIKey is SUKBYIOYMLMADR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN3O2/c20-14-7-8-16-17(10-14)23-18(22-16)12-3-5-13(6-4-12)19(24)21-11-15-2-1-9-25-15/h1-10H,11H2,(H,21,24)(H,22,23).
What are the key properties of 4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide?
4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide has a molecular weight of 351.79 g/mol, XLogP of 4.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 100579855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).